2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide

C14H15N7O3 — CID 4846985

IUPAC2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCC1(C)NC(=O)N(CC(=O)Nc2ccc(-n3cnnn3)cc2)C1=O
InChIInChI=1S/C14H15N7O3/c1-14(2)12(23)20(13(24)17-14)7-11(22)16-9-3-5-10(6-4-9)21-8-15-18-19-21/h3-6,8H,7H2,1-2H3,(H,16,22)(H,17,24)
InChIKeyNNQGJMOQXLUMCU-UHFFFAOYSA-N
MW329.32 g/mol
LogP-0.07
Rot. Bonds4

About 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 4846985) has the molecular formula C14H15N7O3 and a molecular weight of 329.32 g/mol. Its IUPAC name is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID4846985
Molecular FormulaC14H15N7O3
Molecular Weight329.32 g/mol
Exact Mass329.12
IUPAC Name2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESCC1(C)NC(=O)N(CC(=O)Nc2ccc(-n3cnnn3)cc2)C1=O
InChIInChI=1S/C14H15N7O3/c1-14(2)12(23)20(13(24)17-14)7-11(22)16-9-3-5-10(6-4-9)21-8-15-18-19-21/h3-6,8H,7H2,1-2H3,(H,16,22)(H,17,24)
InChIKeyNNQGJMOQXLUMCU-UHFFFAOYSA-N
XLogP-0.07
TPSA122.11 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.32
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 4847095
1-N-cyclohexyl-2-N-[4-(tetrazol-1-yl)phenyl]pyrrolidine-1,2-dicarboxamide
CID 654097
1-[2-(1-Phenyltetrazol-5-yl)sulfanylacetyl]imidazolidin-2-one
CID 718065
N-[4-(acetylamino)phenyl]-3-(1H-tetrazol-1-yl)propanamide
CID 5297376
N-[4-(1H-tetrazol-1-yl)phenyl]acetamide
CID 539520
N-(4-aminophenyl)-2-(1H-1,2,4-triazol-1-yl)propanamide
CID 16788251
4-(1-Phenyltetrazol-5-yl)piperazin-2-one
CID 2540535
2-(4-Phenyl-piperazin-1-yl)-N-(4-tetrazol-1-yl-phenyl)-acetamide
CID 655936
Pyrrolidine-1,2-dicarboxylic acid 1-[(3,5-dimethyl-phenyl)-amide] 2-[(4-tetrazol-1-yl-phenyl)-amide]
CID 3230214
1-N-(2,6-dimethylphenyl)-2-N-[4-(tetrazol-1-yl)phenyl]pyrrolidine-1,2-dicarboxamide
CID 3230349
3-methyl-N-[4-(1H-tetrazol-1-yl)phenyl]butanamide
CID 17012348
2-ethyl-N-[4-(1H-tetrazol-1-yl)phenyl]butanamide
CID 17012349

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide (CID 4846985) is 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide is CC1(C)NC(=O)N(CC(=O)Nc2ccc(-n3cnnn3)cc2)C1=O.
What is the InChIKey of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is NNQGJMOQXLUMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7O3/c1-14(2)12(23)20(13(24)17-14)7-11(22)16-9-3-5-10(6-4-9)21-8-15-18-19-21/h3-6,8H,7H2,1-2H3,(H,16,22)(H,17,24).
What are the key properties of 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 329.32 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 4846985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).